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3031-74-1

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3031-74-1 Usage

Chemical Properties

Ethyl hydroperoxide is the organic compound with the formula CH3CH2OOH. It is a colorless liquid that is miscible with water and diethyl ether.

Preparation

Ethyl hydroperoxide is formed in the flame of burning alkanes. Ethyl hydroperoxide is also formed in the catalytic reaction of ethane and hydrogen peroxide. Yet another way to form ethyl hydroperoxide is by a photocatalytic oxidation of ethane:CH3CH3 + O2 → CH3CH2OOH

Safety Profile

Explodes violently when superheated. The barium salt is heat and impact-sensitive. Explosive reaction with hydroiodic acid or finely divided silver. When heated to decomposition it emitsacrid smoke and irritating fumes. See also PEROXIDES.

Check Digit Verification of cas no

The CAS Registry Mumber 3031-74-1 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 3,0,3 and 1 respectively; the second part has 2 digits, 7 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 3031-74:
(6*3)+(5*0)+(4*3)+(3*1)+(2*7)+(1*4)=51
51 % 10 = 1
So 3031-74-1 is a valid CAS Registry Number.
InChI:InChI=1/C2H6O2/c1-2-4-3/h3H,2H2,1H3

3031-74-1SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name hydroperoxyethane

1.2 Other means of identification

Product number -
Other names Hydroperoxide,ethyl

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:3031-74-1 SDS

3031-74-1Synthetic route

ethane
74-84-0

ethane

A

peracetic acid
79-21-0

peracetic acid

B

methyl hydroperoxide
3031-73-0

methyl hydroperoxide

C

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

D

hydroxymethylhydroperoxide
15932-89-5

hydroxymethylhydroperoxide

Conditions
ConditionsYield
With nitrogen; oxygen; chlorine at 24.85℃; under 760 Torr; for 0.5h; Kinetics; Oxidation; Photolysis;A 2%
B 6.2%
C 10.2%
D 0.4%
propane
74-98-6

propane

A

peracetic acid
79-21-0

peracetic acid

B

methyl hydroperoxide
3031-73-0

methyl hydroperoxide

C

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

D

hydroxymethylhydroperoxide
15932-89-5

hydroxymethylhydroperoxide

Conditions
ConditionsYield
With nitrogen; oxygen; chlorine at 24.85℃; under 760 Torr; for 0.333333h; Kinetics; Oxidation; Photolysis;A 0.1%
B 3.39%
C 0.61%
D 0.14%
diethyl sulfate
64-67-5

diethyl sulfate

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

Conditions
ConditionsYield
With dihydrogen peroxide
With dihydrogen peroxide
With potassium hydroxide; dihydrogen peroxide man saeuert 10-stdg. Schuetteln mit Schwefelsaeure an und destilliert das zwischen 90grad und 100grad uebergegangene Destillat wird mit Kalilauge versetzt und im Vakuum konzentriert darauf saeuert man abermals an und destilliert ueber;
With potassium hydroxide; dihydrogen peroxide In water Heating;
diethyl sulfate
64-67-5

diethyl sulfate

A

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

B

diethyl peroxide
628-37-5

diethyl peroxide

Conditions
ConditionsYield
With dihydrogen peroxide
ethane
74-84-0

ethane

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

Conditions
ConditionsYield
With oxygen at 25℃; Irradiation.mit UV-Licht <253.7 nm; Quecksilber-Sensibilisierung>;
With AuPd; dihydrogen peroxide In water at 21℃; under 750.075 Torr; for 1h;
ethylmagnesium chloride
2386-64-3

ethylmagnesium chloride

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

Conditions
ConditionsYield
With diethyl ether; oxygen at -75℃;
ethane
74-84-0

ethane

A

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

B

ethylperoxy radical
3170-61-4

ethylperoxy radical

Conditions
ConditionsYield
With hydrogen; fluorine at -63.1 - 89.9℃; Rate constant; Irradiation; investigated by flash photolysis-time-resolved UV spectroscopy;
ethane
74-84-0

ethane

A

methanol
67-56-1

methanol

B

formaldehyd
50-00-0

formaldehyd

C

formic acid
64-18-6

formic acid

D

ethene
74-85-1

ethene

E

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

F

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
With nitrogen; oxygen; chlorine at 298℃; under 700 Torr; for 4h; Product distribution; Irradiation;
azoethane
821-14-7

azoethane

A

ethanol
64-17-5

ethanol

B

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

C

diethyl peroxide
628-37-5

diethyl peroxide

D

carbon dioxide
124-38-9

carbon dioxide

E

carbon monoxide
201230-82-2

carbon monoxide

F

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
With nitrogen; oxygen at 298℃; under 700 Torr; for 0.416667h; Product distribution; Irradiation;
diethyl sulphide
70-29-1

diethyl sulphide

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

Conditions
ConditionsYield
With dihydrogen peroxide
ethylperoxy radical
3170-61-4

ethylperoxy radical

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

Conditions
ConditionsYield
With hydroperoxyl at -63.1 - 89.9℃; Rate constant; Mechanism; Irradiation; investigated by flash photolysis-time-resolved UV spectroscopy;
With HO2 at 24.84℃; under 75 Torr; Kinetics; Further Variations:; Pressures; Temperatures;
ethylperoxy radical
3170-61-4

ethylperoxy radical

A

ethanol
64-17-5

ethanol

B

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

C

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
With oxygen In gaseous matrix Kinetics; Mechanism; Irradiation; in nitrogen-atmosphere; variation of oxygen pressure;
E-azoethane
15463-99-7

E-azoethane

A

ethanol
64-17-5

ethanol

B

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

C

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
With oxygen In gaseous matrix Product distribution; Mechanism; Kinetics; Irradiation; in nitrogen-atmosphere; variation of oxygen pressure;
ethane
74-84-0

ethane

A

ethanol
64-17-5

ethanol

B

ethene
74-85-1

ethene

C

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

D

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
With oxygen; chlorine at 255.9℃; under 1000 Torr; Product distribution; Kinetics; Mechanism; Irradiation; ΔH(excit.), variation of pressure;
ethyl radical
2025-56-1

ethyl radical

A

ethanol
64-17-5

ethanol

B

ethene
74-85-1

ethene

C

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

D

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
With oxygen at 255.9℃; under 1000 Torr; Product distribution; Kinetics; Mechanism; ΔH(excit.), variation of pressure;
ethane
74-84-0

ethane

A

ethanol
64-17-5

ethanol

B

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

C

acetaldehyde
75-07-0

acetaldehyde

D

acetic acid
64-19-7

acetic acid

Conditions
ConditionsYield
With 2-pyrazylcarboxylic acid; air; dihydrogen peroxide; [n-Bu4N]VO3 In acetonitrile at 40 - 75℃; Product distribution; Mechanism;
With dihydrogen peroxide; chromic acid In acetonitrile at 60℃; under 22501.8 Torr; for 1h; Product distribution;
With 2-pyrazylcarboxylic acid; C30H34N4O10V2; dihydrogen peroxide In water; acetonitrile at 50℃; under 7600.51 Torr; for 6h; Catalytic behavior; Kinetics; Time; Autoclave; Overall yield = 10 %;
ethane
74-84-0

ethane

A

ethanol
64-17-5

ethanol

B

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

C

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
With air; tris(μ-oxo)di[(1,4,7-trimethyl-1,4,7-triazanonane)manganese(IV)] hexafluorophosphate; dihydrogen peroxide; acetic acid In acetonitrile at 0℃; under 750.06 Torr; for 21h; Product distribution; Mechanism;
With dihydrogen peroxide; iron(III) perchlorate In acetonitrile at 25℃; under 20252 Torr; for 3h; Product distribution; Further Variations:; Catalysts;
diethyl sulfate
64-67-5

diethyl sulfate

alkali

alkali

hydroperoxide

hydroperoxide

A

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

B

diethyl peroxide
628-37-5

diethyl peroxide

ethane
74-84-0

ethane

oxygen

oxygen

3P1-mercury

3P1-mercury

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

Conditions
ConditionsYield
at 40 - 200℃; Kinetics;
1-(ethylperoxy)ethanol
28567-28-4

1-(ethylperoxy)ethanol

water
7732-18-5

water

A

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

B

acetaldehyde
75-07-0

acetaldehyde

1-ethylperoxy-propan-1-ol

1-ethylperoxy-propan-1-ol

water
7732-18-5

water

A

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

B

propionaldehyde
123-38-6

propionaldehyde

ethylperoxy radical
3170-61-4

ethylperoxy radical

A

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

B

O2

O2

Conditions
ConditionsYield
With HO2 In gas at -25.1℃; under 760 Torr; Kinetics; up to 480 K;
diperoxyterephthalic acid diethyl ester
108991-57-7

diperoxyterephthalic acid diethyl ester

water
7732-18-5

water

A

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

B

terephthalic acid
100-21-0

terephthalic acid

diperoxyterephthalic acid diethyl ester
108991-57-7

diperoxyterephthalic acid diethyl ester

aqueous alkali

aqueous alkali

A

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

B

terephthalic acid
100-21-0

terephthalic acid

Ethyl peroxybenzoate
121519-87-7

Ethyl peroxybenzoate

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

Conditions
ConditionsYield
With bis(tri-n-butyltin)oxide In diethyl ether at -10℃; for 12h;
ethane
74-84-0

ethane

A

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

B

acetaldehyde
75-07-0

acetaldehyde

C

acetic acid
64-19-7

acetic acid

Conditions
ConditionsYield
With 2-pyrazylcarboxylic acid; dihydrogen peroxide; [Fe2(HPTB)(μ-OH)(NO3)2](NO3)2*CH3OH*2H2O In acetonitrile at 25℃; under 22501.8 Torr; for 6h; Product distribution;
With AuPd; dihydrogen peroxide In water at 21℃; under 750.075 Torr; for 1h; Time;
With oxygen at 35℃; for 2h; Temperature; Irradiation; Autoclave;
ethane
74-84-0

ethane

A

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

B

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
With oxygen; chlorine In methanol Product distribution; Further Variations:; Solvents;
(tetraphenylporphyrin)(germanium(IV))(ethylhydroperoxide)2
126327-28-4

(tetraphenylporphyrin)(germanium(IV))(ethylhydroperoxide)2

A

dihydroxo(meso-tetraphenylporphyrinato)germanium(IV)
41150-80-5

dihydroxo(meso-tetraphenylporphyrinato)germanium(IV)

B

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

Conditions
ConditionsYield
With water In benzene water is added to benzene soln. of TPPGe(OOCH2CH3)2; detected by NMR spectroscopy;
(tetraphenylporphyrin)(germanium(IV))(OOCH2CH3)(CH2CH3)
74344-36-8

(tetraphenylporphyrin)(germanium(IV))(OOCH2CH3)(CH2CH3)

A

(tetraphenylporphyrin)(germanium(IV))(Cl)(CH2CH3)
126294-64-2

(tetraphenylporphyrin)(germanium(IV))(Cl)(CH2CH3)

B

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

Conditions
ConditionsYield
With hydrogen chloride treatment of TPPGe(OOCH2CH3)(CH2CH3) with hydrogen chloride; (1)H-NMR;
dihydroxo(meso-tetraphenylporphyrinato)germanium(IV)
41150-80-5

dihydroxo(meso-tetraphenylporphyrinato)germanium(IV)

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

(tetraphenylporphyrin)(germanium(IV))(ethylhydroperoxide)2
126327-28-4

(tetraphenylporphyrin)(germanium(IV))(ethylhydroperoxide)2

Conditions
ConditionsYield
In diethyl ether; dichloromethane soln. of ethyl hydroperoxide in ether is added to TPPGe(OH)2 dissolved in dichloromethane in a darkened room, stirring for 5 min; solvent is removed (vac.); (1)H-NMR;92%
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

methoxyethylether
70299-48-8

methoxyethylether

Conditions
ConditionsYield
With Petroleum ether
formaldehyd
50-00-0

formaldehyd

diethyl ether
60-29-7

diethyl ether

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

ethylperoxy-methanol
856340-88-0

ethylperoxy-methanol

Conditions
ConditionsYield
reagiert analog mit Acetaldehyd und Propionaldehyd;
formaldehyd
50-00-0

formaldehyd

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

ethylperoxy-methanol
856340-88-0

ethylperoxy-methanol

Conditions
ConditionsYield
With diethyl ether
ethyl nitrite
109-95-5

ethyl nitrite

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

ethyl nitrate
625-58-1

ethyl nitrate

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

ethyl nitrate
625-58-1

ethyl nitrate

Conditions
ConditionsYield
With cis-nitrous acid
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

A

formaldehyd
50-00-0

formaldehyd

B

ethanol
64-17-5

ethanol

C

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
at 170 - 200℃; bei langsamer Zersetztung;
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

2-ethoxy-1-methyl-6,8-dinitro-1,2-dihydro-quinoline
894-61-1

2-ethoxy-1-methyl-6,8-dinitro-1,2-dihydro-quinoline

ethyl-(1-methyl-6,8-dinitro-1,2-dihydro-[2]quinolyl)-peroxide
100115-45-5

ethyl-(1-methyl-6,8-dinitro-1,2-dihydro-[2]quinolyl)-peroxide

Conditions
ConditionsYield
With acetic acid; benzene
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

phenylacetonitrile
140-29-4

phenylacetonitrile

2-phenyl-peroxyacetimidic acid ethyl ester

2-phenyl-peroxyacetimidic acid ethyl ester

Conditions
ConditionsYield
With sodium hydroxide at 50 - 60℃;
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

acetaldehyde
75-07-0

acetaldehyde

1-(ethylperoxy)ethanol
28567-28-4

1-(ethylperoxy)ethanol

Conditions
ConditionsYield
With diethyl ether
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

propionaldehyde
123-38-6

propionaldehyde

1-ethylperoxy-propan-1-ol

1-ethylperoxy-propan-1-ol

Conditions
ConditionsYield
With diethyl ether
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

butyraldehyde
123-72-8

butyraldehyde

ethyl-(1-hydroxy-butyl)-peroxide

ethyl-(1-hydroxy-butyl)-peroxide

Conditions
ConditionsYield
With diethyl ether
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

propionic acid
802294-64-0

propionic acid

methylammonium carbonate
15719-64-9, 15719-76-3, 97762-63-5

methylammonium carbonate

Conditions
ConditionsYield
in Gegenwart von Mohrschem Salz;
formaldehyd
50-00-0

formaldehyd

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

dimethyl amine
124-40-3

dimethyl amine

ethylperoxymethyl-dimethyl-amine
98138-18-2

ethylperoxymethyl-dimethyl-amine

Conditions
ConditionsYield
With water
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

dimethyl sulfate
77-78-1

dimethyl sulfate

methoxyethylether
70299-48-8

methoxyethylether

Conditions
ConditionsYield
With potassium hydroxide anfangs unter Kuehlung, dann bei 70grad;
With potassium hydroxide
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

isovaleraldehyde
590-86-3

isovaleraldehyde

ethyl-(1-hydroxy-3-methyl-butyl)-peroxide

ethyl-(1-hydroxy-3-methyl-butyl)-peroxide

Conditions
ConditionsYield
With diethyl ether
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

isopentyl nitrite
110-46-3

isopentyl nitrite

A

ethyl nitrate
625-58-1

ethyl nitrate

B

i-Amyl alcohol
123-51-3

i-Amyl alcohol

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

isopentyl nitrite
110-46-3

isopentyl nitrite

A

ethyl nitrate
625-58-1

ethyl nitrate

B

pentan-1-ol
71-41-0

pentan-1-ol

ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
With catalase In water at 25℃; Kinetics; Mechanism;
ethyl hydroperoxide
3031-74-1

ethyl hydroperoxide

A

ethanol
64-17-5

ethanol

B

acetaldehyde
75-07-0

acetaldehyde

Conditions
ConditionsYield
(TMP)Fe(III)OH In (2)H8-toluene for 12h; Mechanism;A 11 % Spectr.
B 72 % Spectr.

3031-74-1Relevant articles and documents

Watson,Darwent

, p. 577 (1957)

Cloutour et al.

, p. 157,160 (1977)

Heicklen,Johnston

, p. 4394,4396-4397 (1962)

Callear,Pereira

, p. 2774 (1963)

A new method for the synthesis of primary hydroperoxides. A useful application of bis(tributyltin) oxide in the hydrolysis of peroxyesters

Baj, Stefan,Chrobok, Anna

, p. 623 - 624 (2001)

Hydrolysis of peroxyesters in the presence of bis(tributyltin) oxide provides a new method for the synthesis of hydroperoxides including methyl and ethyl hydroperoxide.

Kinetics and branching ratio studies of the reaction of C2H 5O2 + HO2 using chemical ionisation mass spectrometry

Teresa Raventos-Duran,Percival, Carl J.,McGillen, Max R.,Hamer, Paul D.,Shallcross, Dudley E.

, p. 4338 - 4348 (2007)

The overall rate coefficient for the reaction of C2H 5O2 with HO2 was determined using a turbulent flow chemical ionization mass spectrometer (TF-CIMS) system over the pressure range of 75 to 200 Torr and temperatures between 195 and 298 K. The temperature dependence of the overall rate coefficient for the reaction between C 2H5O2 and HO2 was fitted using the following Arrhenius expression: k(T) = (2.08-0.62+0.87) × 10-13 exp [(864 ± 79)/T] cm-3 molecule -1 s-1. The upper limits for the branching ratios for reactive channels leading to O3 and OH production were quantified for the first time. A tropospheric model has been used to assess the impact of the experimental error of the rate coefficients determined in this study on predicted concentrations of a number of key species, including O3, OH, HO2, NO and NO2. In all cases it is found that the propagated error is very small and will not in itself be a major cause of uncertainty in modelled concentrations. However, at low temperatures, where there is a wide discrepancy between existing kinetic studies, modelling using the range of kinetic data in the literature shows a small but significant variation for [C2H5O2], [C2H 5OOH], [NOx] and the HO2:OH ratio. Furthermore, a structure-activity relationship (SAR) was developed to rationalise the reactivity of the reaction between RO2 and HO2. the Owner Societies.

Highly efficient visible-light photocatalytic ethane oxidation into ethyl hydroperoxide as a radical reservoir

Zhu, Yao,Fang, Siyuan,Chen, Shaoqin,Tong, Youjie,Wang, Chunling,Hu, Yun Hang

, p. 5825 - 5833 (2021/05/07)

Photocatalytic ethane conversion into value-added chemicals is a great challenge especially under visible light irradiation. The production of ethyl hydroperoxide (CH3CH2OOH), which is a promising radical reservoir for regulating the oxidative stress in cells, is even more challenging due to its facile decomposition. Here, we demonstrated a design of a highly efficient visible-light-responsive photocatalyst, Au/WO3, for ethane oxidation into CH3CH2OOH, achieving an impressive yield of 1887 μmol gcat?1in two hours under visible light irradiation at room temperature for the first time. Furthermore, thermal energy was introduced into the photocatalytic system to increase the driving force for ethane oxidation, enhancing CH3CH2OOH production by six times to 11?233 μmol gcat?1at 100 °C and achieving a significant apparent quantum efficiency of 17.9% at 450 nm. In addition, trapping active species and isotope-labeling reactants revealed the reaction pathway. These findings pave the way for scalable ethane conversion into CH3CH2OOH as a potential anticancer drug.

The Role of Copper Speciation in the Low Temperature Oxidative Upgrading of Short Chain Alkanes over Cu/ZSM-5 Catalysts

Armstrong, Robert D.,Peneau, Virginie,Ritterskamp, Nadine,Kiely, Christopher J.,Taylor, Stuart H.,Hutchings, Graham J.

, p. 469 - 478 (2018/01/27)

Partial oxidative upgrading of C1–C3 alkanes over Cu/ZSM-5 catalysts prepared by chemical vapour impregnation (CVI) has been studied. The undoped ZSM-5 support is itself able to catalyse selective oxidations, for example, methane to methanol, using mild reaction conditions and the green oxidant H2O2. Addition of Cu suppresses secondary oxidation reactions, affording methanol selectivities of up to 97 %. Characterisation studies attribute this ability to population of specific Cu sites below the level of total exchange (Cu/Al0.5). These species also show activity for radical-based methane oxidation, with productivities exceeding those of the parent zeolite supports. When tested for ethane and propane oxidation reactions, comparable trends are observed.

Partial oxidation of ethane to oxygenates using Fe- and Cu-containing ZSM-5

Forde, Michael M.,Armstrong, Robert D.,Hammond, Ceri,He, Qian,Jenkins, Robert L.,Kondrat, Simon A.,Dimitratos, Nikolaos,Lopez-Sanchez, Jose Antonio,Taylor, Stuart H.,Willock, David,Kiely, Christopher J.,Hutchings, Graham John

supporting information, p. 11087 - 11099 (2013/08/23)

Iron and copper containing ZSM-5 catalysts are effective for the partial oxidation of ethane with hydrogen peroxide giving combined oxygenate selectivities and productivities of up to 95.2% and 65 mol kgcat -1 h-1, respectively. High conversion of ethane (ca. 56%) to acetic acid (ca. 70% selectivity) can be observed. Detailed studies of this catalytic system reveal a complex reaction network in which the oxidation of ethane gives a range of C2 oxygenates, with sequential C-C bond cleavage generating C1 products. We demonstrate that ethene is also formed and can be subsequently oxidized. Ethanol can be directly produced from ethane, and does not originate from the decomposition of its corresponding alkylperoxy species, ethyl hydroperoxide. In contrast to our previously proposed mechanism for methane oxidation over similar zeolite catalysts, the mechanism of ethane oxidation involves carbon-based radicals, which lead to the high conversions we observe.

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